ATOM 42
1 C1y C 30.2221 -28.1978
2 C8y C 29.0361 -27.4304
3 C1y C 31.4778 -27.5001
4 C8y C 29.0361 -26.0351
5 C8y C 27.8501 -28.1280
6 C1y C 31.4778 -26.1048
7 O1a O 32.6638 -28.1978
8 O2x O 30.2918 -25.4072
9 C8x C 27.8501 -25.3374
10 C8x C 26.5944 -27.4304
11 C8y C 26.5941 -26.0351
12 O1a O 25.4084 -25.3374
13 C8y C 32.6638 -25.4072
14 C8x C 33.8499 -26.1048
15 C8x C 32.6638 -24.0119
16 C8y C 35.1057 -25.4072
17 C8x C 33.9197 -23.3142
18 C8y C 35.1057 -24.0119
19 O1a O 36.2917 -26.1048
20 O1a O 36.3614 -23.3142
21 C8y C 30.2221 -30.0819
22 C8y C 31.4778 -30.7098
23 C8y C 29.0361 -30.7098
24 C8y C 31.4778 -32.1748
25 O2x O 32.6638 -30.0819
26 C8x C 29.0361 -32.1748
27 C1x C 32.6638 -32.8725
28 C8y C 30.2221 -32.8725
29 C1y C 33.8499 -30.7795
30 C1y C 33.8499 -32.1748
31 O1a O 30.2221 -34.2678
32 O1a O 35.0359 -32.8725
33 C8y C 35.1057 -30.0819
34 C8x C 36.2917 -30.7795
35 C8x C 35.1057 -28.6866
36 C8y C 37.4777 -30.0819
37 C8x C 36.2917 -27.9889
38 C8y C 37.4777 -28.6866
39 O1a O 38.7334 -30.7795
40 O1a O 38.7334 -27.9889
41 O1a O 27.8500 -30.0819
42 O1a O 27.8513 -29.1748
BOND 47
1 18 20 1
2 17 18 1
3 4 9 1
4 1 21 1 #Up
5 5 10 2
6 9 11 2
7 11 12 1
8 6 8 1
9 10 11 1
10 6 13 1 #Down
11 1 2 1
12 1 3 1
13 2 4 2
14 2 5 1
15 21 22 1
16 21 23 2
17 22 24 2
18 22 25 1
19 23 26 1
20 24 27 1
21 24 28 1
22 25 29 1
23 27 30 1
24 28 31 1
25 30 32 1 #Down
26 26 28 2
27 29 30 1
28 3 6 1
29 29 33 1 #Down
30 3 7 1 #Down
31 4 8 1
32 13 14 2
33 13 15 1
34 14 16 1
35 15 17 2
36 16 18 2
37 33 34 2
38 33 35 1
39 34 36 1
40 35 37 2
41 36 38 2
42 36 39 1
43 38 40 1
44 37 38 1
45 23 41 1
46 16 19 1
47 5 42 1
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